4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(3-methylbutyl)benzamide--oxalic acid (1/1)
Chemical Structure Depiction of
4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(3-methylbutyl)benzamide--oxalic acid (1/1)
4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(3-methylbutyl)benzamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E642-0340 |
| Compound Name: | 4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(3-methylbutyl)benzamide--oxalic acid (1/1) |
| Molecular Weight: | 552.62 |
| Molecular Formula: | C26 H27 F N4 O S |
| Salt: | HOOCCOOH |
| Smiles: | CC(C)CCNC(c1ccc(CSc2nc3cccnc3n2Cc2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3297 |
| logD: | 5.3295 |
| logSw: | -5.2382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.91 |
| InChI Key: | NMXZSZTWGPQJTM-UHFFFAOYSA-N |